1-(4-chlorophenyl)-1-methyl-4-naphthalen-1-yl-3-(thiophen-2-ylmethoxy)piperazin-1-ium

Systemtic Name: 1-(4-chlorophenyl)-1-methyl-4-naphthalen-1-yl-3-(thiophen-2-ylmethoxy)piperazin-1-ium Openeye Name: 1-(4-chlorophenyl)-1-methyl-4-(1-naphthyl)-3-(2-thienylmethoxy)piperazin-1-ium CAS Name: 1-(4-chlorophenyl)-1-methyl-4-(1-naphthalenyl)-3-(thiophen-2-ylmethoxy)piperazin-1-ium IUPAC Name: 1-(4-chlorophenyl)-1-methyl-4-naphthalen-1-yl-3-(thiophen-2-ylmethoxy)piperazin-1-ium Traditional Name: 1-(4-chlorophenyl)-1-methyl-4-(1-naphthyl)-3-(2-thenyloxy)piperazin-1-ium Formula: C26H26ClN2OS+ MolecularWeight: 450.01544

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(C(C1)OCC2=CC=CS2)C3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)Cl

Isomeric SMILES

C[N+]1(CCN(C(C1)OCC2=CC=CS2)C3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H26ClN2OS/c1-29(22-13-11-21(27)12-14-22)16-15-28(26(18-29)30-19-23-8-5-17-31-23)25-10-4-7-20-6-2-3-9-24(20)25/h2-14,17,26H,15-16,18-19H2,1H3/q+1